4-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-3-methyl-aniline

Systemtic Name: 4-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-3-methyl-aniline Openeye Name: 4-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]-3-methyl-aniline CAS Name: 4-[(4-bromo-2,5-dimethoxyphenyl)methylthio]-3-methylaniline IUPAC Name: 4-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]-3-methylaniline Traditional Name: [4-[(4-bromo-2,5-dimethoxy-benzyl)thio]-3-methyl-phenyl]amine Formula: C16H18BrNO2S MolecularWeight: 368.28862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCC2=CC(=C(C=C2OC)Br)OC

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCC2=CC(=C(C=C2OC)Br)OC

InChI

InChI=1S/C16H18BrNO2S/c1-10-6-12(18)4-5-16(10)21-9-11-7-15(20-3)13(17)8-14(11)19-2/h4-8H,9,18H2,1-3H3